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DOE OSTI · 1757200

Materials Data on Mg(BrO3)2 by Materials Project

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Abstract

Mg(O3Br)2 crystallizes in the monoclinic C2/m space group. The structure is two-dimensional and consists of one Mg(O3Br)2 sheet oriented in the (0, 0, 1) direction. Mg2+ is bonded in an octahedral geometry to six O2- atoms. All Mg–O bond lengths are 2.14 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a bent 120 degrees geometry to one Mg2+ and one Br5+ atom. The O–Br bond length is 1.69 Å. In the second O2- site, O2- is bonded in a bent 120 degrees geometry to one Mg2+ and one Br5+ atom. The O–Br bond length is 1.69 Å. Br5+ is bonded in a trigonal non-coplanar geometry to three O2- atoms.

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36 MATERIALS SCIENCEBr-Mg-Ocrystal structureMg(BrO3)2

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2020-09-03. Materials Data on Mg(BrO3)2 by Materials Project. https://doi.org/10.17188/1757200

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